Geometry & MOs

Info

ID:	5859
PubChem CID:	13917
Reduced:	NO2C13H19 (1)
Stoich.:	AB2C13D19 (1)
Weight, g/mol:	221.141579
ΔH_f, kcal/mol:	-90.77
Dipole, Da:	1.76
IP(EA), eV:	-8.79(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-butan-2-yl-4-methylphenyl) N-methylcarbamate

Drug info:

PubChemData

Smile

CCC(C)C1=C(C=CC(=C1)OC(=O)NC)C

DOS

IR

Vibrations